ChemSpider 2D Image | 5-(4-Aminobenzyl)-2-butyl-3-{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}-3,5-dihydro-4H-imidazo[4,5-c]pyridin-4-one | C31H30N8O

5-(4-Aminobenzyl)-2-butyl-3-{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}-3,5-dihydro-4H-imidazo[4,5-c]pyridin-4-one

  • Molecular FormulaC31H30N8O
  • Average mass530.623 Da
  • Monoisotopic mass530.254272 Da
  • ChemSpider ID13752674

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4H-Imidazo[4,5-c]pyridin-4-one, 5-[(4-aminophenyl)methyl]-2-butyl-3,5-dihydro-3-[[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]- [ACD/Index Name]
5-(4-Aminobenzyl)-2-butyl-3-{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}-3,5-dihydro-4H-imidazo[4,5-c]pyridin-4-on [German] [ACD/IUPAC Name]
5-(4-Aminobenzyl)-2-butyl-3-{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}-3,5-dihydro-4H-imidazo[4,5-c]pyridin-4-one [ACD/IUPAC Name]
5-(4-Aminobenzyl)-2-butyl-3-{[2'-(1H-tétrazol-5-yl)-4-biphénylyl]méthyl}-3,5-dihydro-4H-imidazo[4,5-c]pyridin-4-one [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 838.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 121.8±3.0 kJ/mol
Flash Point: 460.9±37.1 °C
Index of Refraction: 1.712
Molar Refractivity: 155.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 14.81
ACD/KOC (pH 5.5): 102.04
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 3.16
ACD/KOC (pH 7.4): 21.77
Polar Surface Area: 119 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 57.2±7.0 dyne/cm
Molar Volume: 398.0±7.0 cm3

Click to predict properties on the Chemicalize site


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